ethyl 2-(4-ethylpiperazin-1-yl)acetate

C10H20N2O2 — CID 22199027

IUPACethyl 2-(4-ethylpiperazin-1-yl)acetate
SMILESCCOC(=O)CN1CCN(CC)CC1
InChIInChI=1S/C10H20N2O2/c1-3-11-5-7-12(8-6-11)9-10(13)14-4-2/h3-9H2,1-2H3
InChIKeyAZYRBDOTCHWMJV-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.19
Rot. Bonds4

About ethyl 2-(4-ethylpiperazin-1-yl)acetate

ethyl 2-(4-ethylpiperazin-1-yl)acetate (PubChem CID 22199027) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is ethyl 2-(4-ethylpiperazin-1-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(4-ethylpiperazin-1-yl)acetate
PubChem CID22199027
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Nameethyl 2-(4-ethylpiperazin-1-yl)acetate
SMILESCCOC(=O)CN1CCN(CC)CC1
InChIInChI=1S/C10H20N2O2/c1-3-11-5-7-12(8-6-11)9-10(13)14-4-2/h3-9H2,1-2H3
InChIKeyAZYRBDOTCHWMJV-UHFFFAOYSA-N
XLogP0.19
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(4-ethylpiperazin-1-yl)acetate?
The IUPAC name of ethyl 2-(4-ethylpiperazin-1-yl)acetate (CID 22199027) is ethyl 2-(4-ethylpiperazin-1-yl)acetate.
What is the SMILES notation for ethyl 2-(4-ethylpiperazin-1-yl)acetate?
The canonical SMILES for ethyl 2-(4-ethylpiperazin-1-yl)acetate is CCOC(=O)CN1CCN(CC)CC1.
What is the InChIKey of ethyl 2-(4-ethylpiperazin-1-yl)acetate?
The InChIKey is AZYRBDOTCHWMJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-11-5-7-12(8-6-11)9-10(13)14-4-2/h3-9H2,1-2H3.
What are the key properties of ethyl 2-(4-ethylpiperazin-1-yl)acetate?
ethyl 2-(4-ethylpiperazin-1-yl)acetate has a molecular weight of 200.28 g/mol, XLogP of 0.19, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(4-ethylpiperazin-1-yl)acetate is sourced from PubChem (CID 22199027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).